N-[1-(4-fluorophenyl)propan-2-yl]piperidin-3-amine

C14H21FN2 — CID 62997030

IUPACN-[1-(4-fluorophenyl)propan-2-yl]piperidin-3-amine
SMILESCC(Cc1ccc(F)cc1)NC1CCCNC1
InChIInChI=1S/C14H21FN2/c1-11(17-14-3-2-8-16-10-14)9-12-4-6-13(15)7-5-12/h4-7,11,14,16-17H,2-3,8-10H2,1H3
InChIKeyKZJNDPSZCZYTPG-UHFFFAOYSA-N
MW236.33 g/mol
LogP2.10
Rot. Bonds4

About N-[1-(4-fluorophenyl)propan-2-yl]piperidin-3-amine

N-[1-(4-fluorophenyl)propan-2-yl]piperidin-3-amine (PubChem CID 62997030) has the molecular formula C14H21FN2 and a molecular weight of 236.33 g/mol. Its IUPAC name is N-[1-(4-fluorophenyl)propan-2-yl]piperidin-3-amine.

Molecular Properties

Compound NameN-[1-(4-fluorophenyl)propan-2-yl]piperidin-3-amine
PubChem CID62997030
Molecular FormulaC14H21FN2
Molecular Weight236.33 g/mol
Exact Mass236.17
IUPAC NameN-[1-(4-fluorophenyl)propan-2-yl]piperidin-3-amine
SMILESCC(Cc1ccc(F)cc1)NC1CCCNC1
InChIInChI=1S/C14H21FN2/c1-11(17-14-3-2-8-16-10-14)9-12-4-6-13(15)7-5-12/h4-7,11,14,16-17H,2-3,8-10H2,1H3
InChIKeyKZJNDPSZCZYTPG-UHFFFAOYSA-N
XLogP2.10
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.33
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-(4-fluorophenyl)propan-2-yl]cyclooctanamine
CID 63464519
N-[1-(4-fluorophenyl)propan-2-yl]-4-propan-2-ylcycloheptan-1-amine
CID 65091426
1-(4-fluorophenyl)-N-(piperidin-3-ylmethyl)propan-2-amine
CID 80555461
N-[1-(4-fluorophenyl)propan-2-yl]-1-methylazepan-4-amine
CID 65074925
4-N-[1-(4-fluorophenyl)propan-2-yl]cyclohexane-1,4-diamine
CID 79741782
N-[1-(4-fluorophenyl)propan-2-yl]-3-methylcyclobutan-1-amine
CID 115892356
N-[1-(4-fluorophenyl)propan-2-yl]-2-piperidin-3-ylacetamide
CID 63010220
1-N-[1-(4-fluorophenyl)propan-2-yl]cyclobutane-1,3-diamine
CID 80562355
N-[1-(4-fluorophenyl)propan-2-yl]-4-(trifluoromethyl)cyclohexan-1-amine
CID 64753673
2-(4-fluorophenyl)-1-piperidin-3-ylethanol
CID 71683765
trans-(1R,2R)-2-[1-(4-fluorophenyl)propan-2-ylamino]cyclopentan-1-ol
CID 102733429
N-[1-(4-fluorophenyl)propan-2-yl]-3-methoxycyclobutan-1-amine
CID 113429558

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-fluorophenyl)propan-2-yl]piperidin-3-amine?
The IUPAC name of N-[1-(4-fluorophenyl)propan-2-yl]piperidin-3-amine (CID 62997030) is N-[1-(4-fluorophenyl)propan-2-yl]piperidin-3-amine.
What is the SMILES notation for N-[1-(4-fluorophenyl)propan-2-yl]piperidin-3-amine?
The canonical SMILES for N-[1-(4-fluorophenyl)propan-2-yl]piperidin-3-amine is CC(Cc1ccc(F)cc1)NC1CCCNC1.
What is the InChIKey of N-[1-(4-fluorophenyl)propan-2-yl]piperidin-3-amine?
The InChIKey is KZJNDPSZCZYTPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21FN2/c1-11(17-14-3-2-8-16-10-14)9-12-4-6-13(15)7-5-12/h4-7,11,14,16-17H,2-3,8-10H2,1H3.
What are the key properties of N-[1-(4-fluorophenyl)propan-2-yl]piperidin-3-amine?
N-[1-(4-fluorophenyl)propan-2-yl]piperidin-3-amine has a molecular weight of 236.33 g/mol, XLogP of 2.10, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-fluorophenyl)propan-2-yl]piperidin-3-amine is sourced from PubChem (CID 62997030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).