N-[[2-[2-(oxolan-2-yl)ethyl]-4-propan-2-ylcyclohexyl]methyl]cyclopropanamine

C19H35NO — CID 81025758

IUPACN-[[2-[2-(oxolan-2-yl)ethyl]-4-propan-2-ylcyclohexyl]methyl]cyclopropanamine
SMILESCC(C)C1CCC(CNC2CC2)C(CCC2CCCO2)C1
InChIInChI=1S/C19H35NO/c1-14(2)15-5-6-17(13-20-18-8-9-18)16(12-15)7-10-19-4-3-11-21-19/h14-20H,3-13H2,1-2H3
InChIKeyHAJIORXHYQQZRP-UHFFFAOYSA-N
MW293.50 g/mol
LogP4.39
Rot. Bonds7

About N-[[2-[2-(oxolan-2-yl)ethyl]-4-propan-2-ylcyclohexyl]methyl]cyclopropanamine

N-[[2-[2-(oxolan-2-yl)ethyl]-4-propan-2-ylcyclohexyl]methyl]cyclopropanamine (PubChem CID 81025758) has the molecular formula C19H35NO and a molecular weight of 293.50 g/mol. Its IUPAC name is N-[[2-[2-(oxolan-2-yl)ethyl]-4-propan-2-ylcyclohexyl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[2-[2-(oxolan-2-yl)ethyl]-4-propan-2-ylcyclohexyl]methyl]cyclopropanamine
PubChem CID81025758
Molecular FormulaC19H35NO
Molecular Weight293.50 g/mol
Exact Mass293.27
IUPAC NameN-[[2-[2-(oxolan-2-yl)ethyl]-4-propan-2-ylcyclohexyl]methyl]cyclopropanamine
SMILESCC(C)C1CCC(CNC2CC2)C(CCC2CCCO2)C1
InChIInChI=1S/C19H35NO/c1-14(2)15-5-6-17(13-20-18-8-9-18)16(12-15)7-10-19-4-3-11-21-19/h14-20H,3-13H2,1-2H3
InChIKeyHAJIORXHYQQZRP-UHFFFAOYSA-N
XLogP4.39
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.50
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[[2-[2-(oxolan-2-yl)ethyl]-4-propan-2-ylcyclohexyl]methyl]cyclopropanamine with MolForge

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Related Compounds

N-[(2-hexyl-4-propan-2-ylcyclohexyl)methyl]cyclopropanamine
CID 81030673
2-(oxolan-2-ylmethyl)-4-propan-2-ylcyclohexan-1-amine
CID 62740576
N-[[2-(oxan-4-yl)-4-propan-2-ylcyclohexyl]methyl]cyclopropanamine
CID 81031196
N-[(2-methylcyclopropyl)methyl]-4-propan-2-ylcyclohexan-1-amine
CID 115652182
1-N-methyl-4-N-(oxolan-2-ylmethyl)cyclohexane-1,4-diamine
CID 117027418
N-methyl-1-(4-propan-2-yl-2-propylcyclohexyl)methanamine
CID 81028967
N-methyl-1-[2-[2-(oxolan-2-yl)ethyl]cyclopentyl]methanamine
CID 81034767
N-[[2-[3-(oxolan-2-yl)propyl]cyclobutyl]methyl]propan-2-amine
CID 81017533
2-methyl-N-[[2-[2-(oxolan-2-yl)ethyl]cycloheptyl]methyl]propan-1-amine
CID 81025739
2-[(cyclopropylamino)methyl]-N-methyl-N-(oxolan-2-ylmethyl)cyclobutan-1-amine
CID 80998923
N-[(2-pentan-2-yl-4-propan-2-ylcyclohexyl)methyl]cyclopropanamine
CID 107889421
2-[[methyl(oxolan-2-ylmethyl)amino]methyl]-4-propan-2-ylcyclohexan-1-ol
CID 62708323

Frequently Asked Questions

What is the IUPAC name of N-[[2-[2-(oxolan-2-yl)ethyl]-4-propan-2-ylcyclohexyl]methyl]cyclopropanamine?
The IUPAC name of N-[[2-[2-(oxolan-2-yl)ethyl]-4-propan-2-ylcyclohexyl]methyl]cyclopropanamine (CID 81025758) is N-[[2-[2-(oxolan-2-yl)ethyl]-4-propan-2-ylcyclohexyl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[2-[2-(oxolan-2-yl)ethyl]-4-propan-2-ylcyclohexyl]methyl]cyclopropanamine?
The canonical SMILES for N-[[2-[2-(oxolan-2-yl)ethyl]-4-propan-2-ylcyclohexyl]methyl]cyclopropanamine is CC(C)C1CCC(CNC2CC2)C(CCC2CCCO2)C1.
What is the InChIKey of N-[[2-[2-(oxolan-2-yl)ethyl]-4-propan-2-ylcyclohexyl]methyl]cyclopropanamine?
The InChIKey is HAJIORXHYQQZRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H35NO/c1-14(2)15-5-6-17(13-20-18-8-9-18)16(12-15)7-10-19-4-3-11-21-19/h14-20H,3-13H2,1-2H3.
What are the key properties of N-[[2-[2-(oxolan-2-yl)ethyl]-4-propan-2-ylcyclohexyl]methyl]cyclopropanamine?
N-[[2-[2-(oxolan-2-yl)ethyl]-4-propan-2-ylcyclohexyl]methyl]cyclopropanamine has a molecular weight of 293.50 g/mol, XLogP of 4.39, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-[2-(oxolan-2-yl)ethyl]-4-propan-2-ylcyclohexyl]methyl]cyclopropanamine is sourced from PubChem (CID 81025758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).