N-(cyclopropylmethyl)-1-[(2-methylcyclopropyl)methyl]piperidin-4-amine;hydrochloride

C14H27ClN2 — CID 120841537

IUPACN-(cyclopropylmethyl)-1-[(2-methylcyclopropyl)methyl]piperidin-4-amine;hydrochloride
SMILESCC1CC1CN1CCC(NCC2CC2)CC1.Cl
InChIInChI=1S/C14H26N2.ClH/c1-11-8-13(11)10-16-6-4-14(5-7-16)15-9-12-2-3-12;/h11-15H,2-10H2,1H3;1H
InChIKeyNZHYJKZRZURXAS-UHFFFAOYSA-N
MW258.84 g/mol
LogP2.53
Rot. Bonds5

About N-(cyclopropylmethyl)-1-[(2-methylcyclopropyl)methyl]piperidin-4-amine;hydrochloride

N-(cyclopropylmethyl)-1-[(2-methylcyclopropyl)methyl]piperidin-4-amine;hydrochloride (PubChem CID 120841537) has the molecular formula C14H27ClN2 and a molecular weight of 258.84 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-1-[(2-methylcyclopropyl)methyl]piperidin-4-amine;hydrochloride.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-1-[(2-methylcyclopropyl)methyl]piperidin-4-amine;hydrochloride
PubChem CID120841537
Molecular FormulaC14H27ClN2
Molecular Weight258.84 g/mol
Exact Mass258.19
IUPAC NameN-(cyclopropylmethyl)-1-[(2-methylcyclopropyl)methyl]piperidin-4-amine;hydrochloride
SMILESCC1CC1CN1CCC(NCC2CC2)CC1.Cl
InChIInChI=1S/C14H26N2.ClH/c1-11-8-13(11)10-16-6-4-14(5-7-16)15-9-12-2-3-12;/h11-15H,2-10H2,1H3;1H
InChIKeyNZHYJKZRZURXAS-UHFFFAOYSA-N
XLogP2.53
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.84
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 119926349
N-(cyclopropylmethyl)-1-(thiolan-3-ylmethyl)piperidin-4-amine;hydrochloride
CID 120841663
N-(cyclobutylmethyl)-1-ethylpiperidin-4-amine
CID 43298506
1-(2-aminoethyl)-N-(cyclopropylmethyl)piperidin-4-amine
CID 121230314
N-(cyclopropylmethyl)-1-(2-methylprop-2-enyl)piperidin-4-amine
CID 78946388
N-(cyclopropylmethyl)-1-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]piperidin-4-amine;dihydrochloride
CID 119926784
N-[[1-[(4-methylcyclohexyl)methyl]pyrrolidin-3-yl]methyl]cyclopropanamine
CID 63243855
N-[(1-ethylpiperidin-4-yl)methyl]-3,4-dimethylcyclohexan-1-amine
CID 64746015
N-[(2-methylcyclopropyl)methyl]-1-propan-2-ylpiperidin-4-amine
CID 115713087
N-(cyclopropylmethyl)-4-methylcyclohexan-1-amine
CID 43190640
2-[4-(cyclopropylmethylamino)piperidin-1-yl]-N-(2,3-dimethylcyclohexyl)acetamide;hydrochloride
CID 119926459
1-(cyclopropylmethyl)-N-(2-methoxyethyl)piperidin-4-amine
CID 115705566

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-1-[(2-methylcyclopropyl)methyl]piperidin-4-amine;hydrochloride?
The IUPAC name of N-(cyclopropylmethyl)-1-[(2-methylcyclopropyl)methyl]piperidin-4-amine;hydrochloride (CID 120841537) is N-(cyclopropylmethyl)-1-[(2-methylcyclopropyl)methyl]piperidin-4-amine;hydrochloride.
What is the SMILES notation for N-(cyclopropylmethyl)-1-[(2-methylcyclopropyl)methyl]piperidin-4-amine;hydrochloride?
The canonical SMILES for N-(cyclopropylmethyl)-1-[(2-methylcyclopropyl)methyl]piperidin-4-amine;hydrochloride is CC1CC1CN1CCC(NCC2CC2)CC1.Cl.
What is the InChIKey of N-(cyclopropylmethyl)-1-[(2-methylcyclopropyl)methyl]piperidin-4-amine;hydrochloride?
The InChIKey is NZHYJKZRZURXAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2.ClH/c1-11-8-13(11)10-16-6-4-14(5-7-16)15-9-12-2-3-12;/h11-15H,2-10H2,1H3;1H.
What are the key properties of N-(cyclopropylmethyl)-1-[(2-methylcyclopropyl)methyl]piperidin-4-amine;hydrochloride?
N-(cyclopropylmethyl)-1-[(2-methylcyclopropyl)methyl]piperidin-4-amine;hydrochloride has a molecular weight of 258.84 g/mol, XLogP of 2.53, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-1-[(2-methylcyclopropyl)methyl]piperidin-4-amine;hydrochloride is sourced from PubChem (CID 120841537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).