4,4-dimethyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylcyclohexan-1-amine

C17H34N2 — CID 106624301

IUPAC4,4-dimethyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylcyclohexan-1-amine
SMILESCC(C)N(CC1CCCNC1)C1CCC(C)(C)CC1
InChIInChI=1S/C17H34N2/c1-14(2)19(13-15-6-5-11-18-12-15)16-7-9-17(3,4)10-8-16/h14-16,18H,5-13H2,1-4H3
InChIKeyLKQJFMNJAITWEO-UHFFFAOYSA-N
MW266.47 g/mol
LogP3.67
Rot. Bonds4

About 4,4-dimethyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylcyclohexan-1-amine

4,4-dimethyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylcyclohexan-1-amine (PubChem CID 106624301) has the molecular formula C17H34N2 and a molecular weight of 266.47 g/mol. Its IUPAC name is 4,4-dimethyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylcyclohexan-1-amine.

Molecular Properties

Compound Name4,4-dimethyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylcyclohexan-1-amine
PubChem CID106624301
Molecular FormulaC17H34N2
Molecular Weight266.47 g/mol
Exact Mass266.27
IUPAC Name4,4-dimethyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylcyclohexan-1-amine
SMILESCC(C)N(CC1CCCNC1)C1CCC(C)(C)CC1
InChIInChI=1S/C17H34N2/c1-14(2)19(13-15-6-5-11-18-12-15)16-7-9-17(3,4)10-8-16/h14-16,18H,5-13H2,1-4H3
InChIKeyLKQJFMNJAITWEO-UHFFFAOYSA-N
XLogP3.67
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.47
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,4,4-trimethyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylcyclopentan-1-amine
CID 106663562
3-ethyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylcyclopentan-1-amine
CID 106624200
2-methyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylcyclohexan-1-amine
CID 106624180
2-methylsulfonyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylcyclopentan-1-amine
CID 106624303
4,4-dimethyl-N-(piperidin-2-ylmethyl)-N-propan-2-ylcyclohexan-1-amine
CID 106622300
N-(piperidin-3-ylmethyl)-N-propan-2-yl-2-propyloxan-4-amine
CID 106624199
N-(piperidin-3-ylmethyl)-N-propan-2-ylcyclohex-2-en-1-amine
CID 106637323
N-(cycloheptylmethyl)-N-(piperidin-3-ylmethyl)propan-2-amine
CID 106624258
N-cyclopropyl-N-(piperidin-3-ylmethyl)spiro[4.5]decan-8-amine
CID 106624955
1-methyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylcyclopentane-1-carboxamide
CID 106629148
N-(piperidin-4-ylmethyl)-N-propan-2-ylcyclobutanamine;hydrochloride
CID 119932017
N-cyclopropyl-N-(piperidin-3-ylmethyl)-1-propan-2-ylpiperidin-4-amine
CID 106624960

Frequently Asked Questions

What is the IUPAC name of 4,4-dimethyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylcyclohexan-1-amine?
The IUPAC name of 4,4-dimethyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylcyclohexan-1-amine (CID 106624301) is 4,4-dimethyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylcyclohexan-1-amine.
What is the SMILES notation for 4,4-dimethyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylcyclohexan-1-amine?
The canonical SMILES for 4,4-dimethyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylcyclohexan-1-amine is CC(C)N(CC1CCCNC1)C1CCC(C)(C)CC1.
What is the InChIKey of 4,4-dimethyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylcyclohexan-1-amine?
The InChIKey is LKQJFMNJAITWEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2/c1-14(2)19(13-15-6-5-11-18-12-15)16-7-9-17(3,4)10-8-16/h14-16,18H,5-13H2,1-4H3.
What are the key properties of 4,4-dimethyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylcyclohexan-1-amine?
4,4-dimethyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylcyclohexan-1-amine has a molecular weight of 266.47 g/mol, XLogP of 3.67, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4-dimethyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylcyclohexan-1-amine is sourced from PubChem (CID 106624301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).