N-[(4-cycloheptylmorpholin-3-yl)methyl]cyclopropanamine

C15H28N2O — CID 83100670

IUPACN-[(4-cycloheptylmorpholin-3-yl)methyl]cyclopropanamine
SMILESC1CCCC(N2CCOCC2CNC2CC2)CC1
InChIInChI=1S/C15H28N2O/c1-2-4-6-14(5-3-1)17-9-10-18-12-15(17)11-16-13-7-8-13/h13-16H,1-12H2
InChIKeyQQMLYSZDTUKXGP-UHFFFAOYSA-N
MW252.40 g/mol
LogP2.16
Rot. Bonds4

About N-[(4-cycloheptylmorpholin-3-yl)methyl]cyclopropanamine

N-[(4-cycloheptylmorpholin-3-yl)methyl]cyclopropanamine (PubChem CID 83100670) has the molecular formula C15H28N2O and a molecular weight of 252.40 g/mol. Its IUPAC name is N-[(4-cycloheptylmorpholin-3-yl)methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[(4-cycloheptylmorpholin-3-yl)methyl]cyclopropanamine
PubChem CID83100670
Molecular FormulaC15H28N2O
Molecular Weight252.40 g/mol
Exact Mass252.22
IUPAC NameN-[(4-cycloheptylmorpholin-3-yl)methyl]cyclopropanamine
SMILESC1CCCC(N2CCOCC2CNC2CC2)CC1
InChIInChI=1S/C15H28N2O/c1-2-4-6-14(5-3-1)17-9-10-18-12-15(17)11-16-13-7-8-13/h13-16H,1-12H2
InChIKeyQQMLYSZDTUKXGP-UHFFFAOYSA-N
XLogP2.16
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.40
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-cyclohexylmorpholin-3-yl)-N-methylmethanamine
CID 83100142
N-[(4-cyclopentylmorpholin-3-yl)methyl]propan-2-amine
CID 83100519
(4-cyclohexylmorpholin-3-yl)methanamine
CID 83095873
N-[[1-(oxan-4-yl)piperidin-2-yl]methyl]cyclopropanamine
CID 63936106
4-cyclobutyl-3-methylmorpholine
CID 131084475
N-(oxolan-3-ylmethyl)cycloheptanamine
CID 43202465
N-(cyclopropylmethyl)-1-(oxan-3-yl)piperidin-4-amine
CID 115306885
N-[[4-(2-butoxyethyl)morpholin-3-yl]methyl]cyclopropanamine
CID 83099766
N-[(1-cyclopentylpiperidin-4-yl)methyl]oxan-3-amine
CID 131906608
(3R)-4-cyclopentyl-3-[2-(3-methylpyrazin-2-yl)ethyl]morpholine
CID 125006767
N-[(1-methylpyrrolidin-2-yl)methyl]oxolan-3-amine
CID 115688929
N-[[(3S)-oxolan-3-yl]methyl]cyclopropanamine
CID 30427697

Frequently Asked Questions

What is the IUPAC name of N-[(4-cycloheptylmorpholin-3-yl)methyl]cyclopropanamine?
The IUPAC name of N-[(4-cycloheptylmorpholin-3-yl)methyl]cyclopropanamine (CID 83100670) is N-[(4-cycloheptylmorpholin-3-yl)methyl]cyclopropanamine.
What is the SMILES notation for N-[(4-cycloheptylmorpholin-3-yl)methyl]cyclopropanamine?
The canonical SMILES for N-[(4-cycloheptylmorpholin-3-yl)methyl]cyclopropanamine is C1CCCC(N2CCOCC2CNC2CC2)CC1.
What is the InChIKey of N-[(4-cycloheptylmorpholin-3-yl)methyl]cyclopropanamine?
The InChIKey is QQMLYSZDTUKXGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O/c1-2-4-6-14(5-3-1)17-9-10-18-12-15(17)11-16-13-7-8-13/h13-16H,1-12H2.
What are the key properties of N-[(4-cycloheptylmorpholin-3-yl)methyl]cyclopropanamine?
N-[(4-cycloheptylmorpholin-3-yl)methyl]cyclopropanamine has a molecular weight of 252.40 g/mol, XLogP of 2.16, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-cycloheptylmorpholin-3-yl)methyl]cyclopropanamine is sourced from PubChem (CID 83100670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).