3-cyclopropyl-N-[(1-cyclopropylpyrrolidin-3-yl)methyl]cyclohexan-1-amine

C17H30N2 — CID 64623574

IUPAC3-cyclopropyl-N-[(1-cyclopropylpyrrolidin-3-yl)methyl]cyclohexan-1-amine
SMILESC1CC(NCC2CCN(C3CC3)C2)CC(C2CC2)C1
InChIInChI=1S/C17H30N2/c1-2-15(14-4-5-14)10-16(3-1)18-11-13-8-9-19(12-13)17-6-7-17/h13-18H,1-12H2
InChIKeyTXAIMYCMZNLLMV-UHFFFAOYSA-N
MW262.44 g/mol
LogP3.03
Rot. Bonds5

About 3-cyclopropyl-N-[(1-cyclopropylpyrrolidin-3-yl)methyl]cyclohexan-1-amine

3-cyclopropyl-N-[(1-cyclopropylpyrrolidin-3-yl)methyl]cyclohexan-1-amine (PubChem CID 64623574) has the molecular formula C17H30N2 and a molecular weight of 262.44 g/mol. Its IUPAC name is 3-cyclopropyl-N-[(1-cyclopropylpyrrolidin-3-yl)methyl]cyclohexan-1-amine.

Molecular Properties

Compound Name3-cyclopropyl-N-[(1-cyclopropylpyrrolidin-3-yl)methyl]cyclohexan-1-amine
PubChem CID64623574
Molecular FormulaC17H30N2
Molecular Weight262.44 g/mol
Exact Mass262.24
IUPAC Name3-cyclopropyl-N-[(1-cyclopropylpyrrolidin-3-yl)methyl]cyclohexan-1-amine
SMILESC1CC(NCC2CCN(C3CC3)C2)CC(C2CC2)C1
InChIInChI=1S/C17H30N2/c1-2-15(14-4-5-14)10-16(3-1)18-11-13-8-9-19(12-13)17-6-7-17/h13-18H,1-12H2
InChIKeyTXAIMYCMZNLLMV-UHFFFAOYSA-N
XLogP3.03
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.44
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-N-[(1-cyclopropylpyrrolidin-3-yl)methyl]cyclohexane-1,3-diamine
CID 79458392
N-[(1-cyclopropylpyrrolidin-3-yl)methyl]thietan-3-amine
CID 155891929
4-[(1-cyclopropylpyrrolidin-3-yl)methylamino]azepan-2-one
CID 63903892
N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-4-ethylcyclohexan-1-amine
CID 54920980
N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-1,5-dimethylpyrrolidin-3-amine
CID 81297545
N-[[1-(3-methylcyclopentyl)pyrrolidin-3-yl]methyl]cyclopropanamine
CID 114546859
N-[[1-(3-ethylcyclohexyl)pyrrolidin-3-yl]methyl]cyclopropanamine
CID 64741079
N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-1-propylazepan-4-amine
CID 65073267
3-cyclopropyl-N-[(4-methylmorpholin-2-yl)methyl]cyclohexan-1-amine
CID 79083040
N-[(1-cyclopropylpiperidin-4-yl)methyl]cyclopropanamine
CID 83907747
N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-2,2-dimethyl-1,3-dioxan-5-amine
CID 106658574
N-(cyclohexylmethyl)-1-cyclopropylpiperidin-3-amine
CID 83998678

Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-N-[(1-cyclopropylpyrrolidin-3-yl)methyl]cyclohexan-1-amine?
The IUPAC name of 3-cyclopropyl-N-[(1-cyclopropylpyrrolidin-3-yl)methyl]cyclohexan-1-amine (CID 64623574) is 3-cyclopropyl-N-[(1-cyclopropylpyrrolidin-3-yl)methyl]cyclohexan-1-amine.
What is the SMILES notation for 3-cyclopropyl-N-[(1-cyclopropylpyrrolidin-3-yl)methyl]cyclohexan-1-amine?
The canonical SMILES for 3-cyclopropyl-N-[(1-cyclopropylpyrrolidin-3-yl)methyl]cyclohexan-1-amine is C1CC(NCC2CCN(C3CC3)C2)CC(C2CC2)C1.
What is the InChIKey of 3-cyclopropyl-N-[(1-cyclopropylpyrrolidin-3-yl)methyl]cyclohexan-1-amine?
The InChIKey is TXAIMYCMZNLLMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N2/c1-2-15(14-4-5-14)10-16(3-1)18-11-13-8-9-19(12-13)17-6-7-17/h13-18H,1-12H2.
What are the key properties of 3-cyclopropyl-N-[(1-cyclopropylpyrrolidin-3-yl)methyl]cyclohexan-1-amine?
3-cyclopropyl-N-[(1-cyclopropylpyrrolidin-3-yl)methyl]cyclohexan-1-amine has a molecular weight of 262.44 g/mol, XLogP of 3.03, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-N-[(1-cyclopropylpyrrolidin-3-yl)methyl]cyclohexan-1-amine is sourced from PubChem (CID 64623574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).