N-[[4-[[cyclopropylmethyl(ethyl)amino]methyl]oxan-4-yl]methyl]cyclopropanamine

C16H30N2O — CID 63955478

IUPACN-[[4-[[cyclopropylmethyl(ethyl)amino]methyl]oxan-4-yl]methyl]cyclopropanamine
SMILESCCN(CC1CC1)CC1(CNC2CC2)CCOCC1
InChIInChI=1S/C16H30N2O/c1-2-18(11-14-3-4-14)13-16(7-9-19-10-8-16)12-17-15-5-6-15/h14-15,17H,2-13H2,1H3
InChIKeyBTJDLFYTALSDJO-UHFFFAOYSA-N
MW266.43 g/mol
LogP2.27
Rot. Bonds8

About N-[[4-[[cyclopropylmethyl(ethyl)amino]methyl]oxan-4-yl]methyl]cyclopropanamine

N-[[4-[[cyclopropylmethyl(ethyl)amino]methyl]oxan-4-yl]methyl]cyclopropanamine (PubChem CID 63955478) has the molecular formula C16H30N2O and a molecular weight of 266.43 g/mol. Its IUPAC name is N-[[4-[[cyclopropylmethyl(ethyl)amino]methyl]oxan-4-yl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[4-[[cyclopropylmethyl(ethyl)amino]methyl]oxan-4-yl]methyl]cyclopropanamine
PubChem CID63955478
Molecular FormulaC16H30N2O
Molecular Weight266.43 g/mol
Exact Mass266.24
IUPAC NameN-[[4-[[cyclopropylmethyl(ethyl)amino]methyl]oxan-4-yl]methyl]cyclopropanamine
SMILESCCN(CC1CC1)CC1(CNC2CC2)CCOCC1
InChIInChI=1S/C16H30N2O/c1-2-18(11-14-3-4-14)13-16(7-9-19-10-8-16)12-17-15-5-6-15/h14-15,17H,2-13H2,1H3
InChIKeyBTJDLFYTALSDJO-UHFFFAOYSA-N
XLogP2.27
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.43
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[[4-[[cyclopropylmethyl(ethyl)amino]methyl]oxan-4-yl]methyl]cyclopropanamine with MolForge

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Related Compounds

N-(cyclopropylmethyl)-N-[[4-(methylaminomethyl)oxan-4-yl]methyl]ethanamine
CID 63955479
N-[[4-[[cyclopropylmethyl(methyl)amino]methyl]oxan-4-yl]methyl]cyclopropanamine
CID 62391146
N-[[1-[[cyclobutylmethyl(ethyl)amino]methyl]cycloheptyl]methyl]cyclopropanamine
CID 107401601
N-(cyclopropylmethyl)-N-[[3-(methylaminomethyl)oxolan-3-yl]methyl]ethanamine
CID 63954673
N-[[1-[[ethyl(oxolan-2-ylmethyl)amino]methyl]cyclopentyl]methyl]cyclopropanamine
CID 62256933
N-[[3-[(dipropylamino)methyl]oxolan-3-yl]methyl]cyclopropanamine
CID 62263014
N-[[4-[[methyl(2-methylpropyl)amino]methyl]oxan-4-yl]methyl]cyclopropanamine
CID 62392859
N-[[4-[(cyclopropylamino)methyl]oxan-4-yl]methyl]-N-methylcyclohexanamine
CID 62392849
[3-[[cyclobutylmethyl(ethyl)amino]methyl]oxolan-3-yl]methanol
CID 107401725
N-[[4-[[butyl(cyclopropyl)amino]methyl]oxan-4-yl]methyl]cyclopropanamine
CID 62391501
N-[[3-[[bis(2-methylpropyl)amino]methyl]oxolan-3-yl]methyl]cyclopropanamine
CID 62257834
N-[[4-(oxan-4-ylmethyl)oxan-4-yl]methyl]cyclopropanamine
CID 62907143

Frequently Asked Questions

What is the IUPAC name of N-[[4-[[cyclopropylmethyl(ethyl)amino]methyl]oxan-4-yl]methyl]cyclopropanamine?
The IUPAC name of N-[[4-[[cyclopropylmethyl(ethyl)amino]methyl]oxan-4-yl]methyl]cyclopropanamine (CID 63955478) is N-[[4-[[cyclopropylmethyl(ethyl)amino]methyl]oxan-4-yl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[4-[[cyclopropylmethyl(ethyl)amino]methyl]oxan-4-yl]methyl]cyclopropanamine?
The canonical SMILES for N-[[4-[[cyclopropylmethyl(ethyl)amino]methyl]oxan-4-yl]methyl]cyclopropanamine is CCN(CC1CC1)CC1(CNC2CC2)CCOCC1.
What is the InChIKey of N-[[4-[[cyclopropylmethyl(ethyl)amino]methyl]oxan-4-yl]methyl]cyclopropanamine?
The InChIKey is BTJDLFYTALSDJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O/c1-2-18(11-14-3-4-14)13-16(7-9-19-10-8-16)12-17-15-5-6-15/h14-15,17H,2-13H2,1H3.
What are the key properties of N-[[4-[[cyclopropylmethyl(ethyl)amino]methyl]oxan-4-yl]methyl]cyclopropanamine?
N-[[4-[[cyclopropylmethyl(ethyl)amino]methyl]oxan-4-yl]methyl]cyclopropanamine has a molecular weight of 266.43 g/mol, XLogP of 2.27, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-[[cyclopropylmethyl(ethyl)amino]methyl]oxan-4-yl]methyl]cyclopropanamine is sourced from PubChem (CID 63955478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).