N-[[5-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]oxolan-2-yl]methyl]cyclopropanamine

C17H28N2OS — CID 79490603

IUPACN-[[5-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]oxolan-2-yl]methyl]cyclopropanamine
SMILESCC(Cc1cccs1)N(C)CC1CCC(CNC2CC2)O1
InChIInChI=1S/C17H28N2OS/c1-13(10-17-4-3-9-21-17)19(2)12-16-8-7-15(20-16)11-18-14-5-6-14/h3-4,9,13-16,18H,5-8,10-12H2,1-2H3
InChIKeyATMIQIWLBDKLOI-UHFFFAOYSA-N
MW308.49 g/mol
LogP2.91
Rot. Bonds8

About N-[[5-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]oxolan-2-yl]methyl]cyclopropanamine

N-[[5-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]oxolan-2-yl]methyl]cyclopropanamine (PubChem CID 79490603) has the molecular formula C17H28N2OS and a molecular weight of 308.49 g/mol. Its IUPAC name is N-[[5-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]oxolan-2-yl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[5-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]oxolan-2-yl]methyl]cyclopropanamine
PubChem CID79490603
Molecular FormulaC17H28N2OS
Molecular Weight308.49 g/mol
Exact Mass308.19
IUPAC NameN-[[5-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]oxolan-2-yl]methyl]cyclopropanamine
SMILESCC(Cc1cccs1)N(C)CC1CCC(CNC2CC2)O1
InChIInChI=1S/C17H28N2OS/c1-13(10-17-4-3-9-21-17)19(2)12-16-8-7-15(20-16)11-18-14-5-6-14/h3-4,9,13-16,18H,5-8,10-12H2,1-2H3
InChIKeyATMIQIWLBDKLOI-UHFFFAOYSA-N
XLogP2.91
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.49
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[[5-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]oxolan-2-yl]methyl]cyclopropanamine with MolForge

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Launch Full Analysis

Related Compounds

N-cyclopropyl-N'-methyl-N'-(1-thiophen-2-ylpropan-2-yl)butane-1,4-diamine
CID 79486010
4-N-methyl-1-N-propyl-4-N-(1-thiophen-2-ylpropan-2-yl)cyclohexane-1,4-diamine
CID 114763468
N-[[5-[[methyl(3-methylbutan-2-yl)amino]methyl]oxolan-2-yl]methyl]cyclopropanamine
CID 62432122
1-N-cyclopropyl-3-N-methyl-3-N-(thiophen-2-ylmethyl)butane-1,3-diamine
CID 62420794
N-(cyclohexylmethyl)-N'-methyl-N'-(1-thiophen-2-ylpropan-2-yl)ethane-1,2-diamine
CID 79494082
N-[[5-[[methyl(thiophen-2-ylmethyl)amino]methyl]oxolan-2-yl]methyl]propan-2-amine
CID 62420415
3-cyclopropyl-1-methyl-1-(1-thiophen-2-ylpropan-2-yl)thiourea
CID 115673593
4-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]cyclopent-2-en-1-amine
CID 79494859
N,2,2-trimethyl-5-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]cyclopentan-1-amine
CID 79855579
N,4-dimethyl-2-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]cyclohexan-1-amine
CID 79486822
N-cyclopropyl-N'-methyl-N'-(thiophen-2-ylmethyl)ethane-1,2-diamine
CID 60843550
N-[[5-[(cyclopropylamino)methyl]oxolan-2-yl]methyl]-N-ethylaniline
CID 62423255

Frequently Asked Questions

What is the IUPAC name of N-[[5-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]oxolan-2-yl]methyl]cyclopropanamine?
The IUPAC name of N-[[5-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]oxolan-2-yl]methyl]cyclopropanamine (CID 79490603) is N-[[5-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]oxolan-2-yl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[5-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]oxolan-2-yl]methyl]cyclopropanamine?
The canonical SMILES for N-[[5-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]oxolan-2-yl]methyl]cyclopropanamine is CC(Cc1cccs1)N(C)CC1CCC(CNC2CC2)O1.
What is the InChIKey of N-[[5-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]oxolan-2-yl]methyl]cyclopropanamine?
The InChIKey is ATMIQIWLBDKLOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2OS/c1-13(10-17-4-3-9-21-17)19(2)12-16-8-7-15(20-16)11-18-14-5-6-14/h3-4,9,13-16,18H,5-8,10-12H2,1-2H3.
What are the key properties of N-[[5-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]oxolan-2-yl]methyl]cyclopropanamine?
N-[[5-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]oxolan-2-yl]methyl]cyclopropanamine has a molecular weight of 308.49 g/mol, XLogP of 2.91, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]oxolan-2-yl]methyl]cyclopropanamine is sourced from PubChem (CID 79490603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).