N-[(1-cyclopropylpiperidin-4-yl)methyl]cyclopropanamine

C12H22N2 — CID 83907747

IUPACN-[(1-cyclopropylpiperidin-4-yl)methyl]cyclopropanamine
SMILESC1CN(C2CC2)CCC1CNC1CC1
InChIInChI=1S/C12H22N2/c1-2-11(1)13-9-10-5-7-14(8-6-10)12-3-4-12/h10-13H,1-9H2
InChIKeyMJOKKMYTEVZHLC-UHFFFAOYSA-N
MW194.32 g/mol
LogP1.61
Rot. Bonds4

About N-[(1-cyclopropylpiperidin-4-yl)methyl]cyclopropanamine

N-[(1-cyclopropylpiperidin-4-yl)methyl]cyclopropanamine (PubChem CID 83907747) has the molecular formula C12H22N2 and a molecular weight of 194.32 g/mol. Its IUPAC name is N-[(1-cyclopropylpiperidin-4-yl)methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[(1-cyclopropylpiperidin-4-yl)methyl]cyclopropanamine
PubChem CID83907747
Molecular FormulaC12H22N2
Molecular Weight194.32 g/mol
Exact Mass194.18
IUPAC NameN-[(1-cyclopropylpiperidin-4-yl)methyl]cyclopropanamine
SMILESC1CN(C2CC2)CCC1CNC1CC1
InChIInChI=1S/C12H22N2/c1-2-11(1)13-9-10-5-7-14(8-6-10)12-3-4-12/h10-13H,1-9H2
InChIKeyMJOKKMYTEVZHLC-UHFFFAOYSA-N
XLogP1.61
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.32
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(cyclopropylmethyl)-1-(1-methylpiperidin-4-yl)piperidin-4-amine
CID 78921372
N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-4-ethylcyclohexan-1-amine
CID 54920980
N-(cyclopropylmethyl)-1-(4-propylcycloheptyl)piperidin-4-amine
CID 115306940
N-[[1-(3-methylcyclopentyl)pyrrolidin-3-yl]methyl]cyclopropanamine
CID 114546859
N-ethyl-4-(4-propylpiperidin-1-yl)cyclohexan-1-amine
CID 114763207
N-[(1-cyclopropylpyrrolidin-3-yl)methyl]thietan-3-amine
CID 155891929
4-[4-(methoxymethyl)piperidin-1-yl]-N-propylcyclohexan-1-amine
CID 114763353
N-[(1-cyclopentylpiperidin-4-yl)methyl]oxan-3-amine
CID 131906608
4-[[(1-cyclopropylpyrrolidin-3-yl)amino]methyl]cyclohexan-1-ol
CID 106126505
N-(cyclopropylmethyl)-1-(oxan-3-yl)piperidin-4-amine
CID 115306885
N-(cyclohexylmethyl)-1-cyclopropylpiperidin-3-amine
CID 83998678
4-(4-ethylazepan-1-yl)-N-propylcyclohexan-1-amine
CID 114763370

Frequently Asked Questions

What is the IUPAC name of N-[(1-cyclopropylpiperidin-4-yl)methyl]cyclopropanamine?
The IUPAC name of N-[(1-cyclopropylpiperidin-4-yl)methyl]cyclopropanamine (CID 83907747) is N-[(1-cyclopropylpiperidin-4-yl)methyl]cyclopropanamine.
What is the SMILES notation for N-[(1-cyclopropylpiperidin-4-yl)methyl]cyclopropanamine?
The canonical SMILES for N-[(1-cyclopropylpiperidin-4-yl)methyl]cyclopropanamine is C1CN(C2CC2)CCC1CNC1CC1.
What is the InChIKey of N-[(1-cyclopropylpiperidin-4-yl)methyl]cyclopropanamine?
The InChIKey is MJOKKMYTEVZHLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2/c1-2-11(1)13-9-10-5-7-14(8-6-10)12-3-4-12/h10-13H,1-9H2.
What are the key properties of N-[(1-cyclopropylpiperidin-4-yl)methyl]cyclopropanamine?
N-[(1-cyclopropylpiperidin-4-yl)methyl]cyclopropanamine has a molecular weight of 194.32 g/mol, XLogP of 1.61, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-cyclopropylpiperidin-4-yl)methyl]cyclopropanamine is sourced from PubChem (CID 83907747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).