N-phenyl-N-piperidin-4-yl-1H-indol-5-amine

C19H21N3 — CID 45267621

IUPACN-phenyl-N-piperidin-4-yl-1H-indol-5-amine
SMILESc1ccc(N(c2ccc3[nH]ccc3c2)C2CCNCC2)cc1
InChIInChI=1S/C19H21N3/c1-2-4-16(5-3-1)22(17-9-11-20-12-10-17)18-6-7-19-15(14-18)8-13-21-19/h1-8,13-14,17,20-21H,9-12H2
InChIKeyVJAXFVGMNNFSQS-UHFFFAOYSA-N
MW291.40 g/mol
LogP4.06
Rot. Bonds3

About N-phenyl-N-piperidin-4-yl-1H-indol-5-amine

N-phenyl-N-piperidin-4-yl-1H-indol-5-amine (PubChem CID 45267621) has the molecular formula C19H21N3 and a molecular weight of 291.40 g/mol. Its IUPAC name is N-phenyl-N-piperidin-4-yl-1H-indol-5-amine.

Molecular Properties

Compound NameN-phenyl-N-piperidin-4-yl-1H-indol-5-amine
PubChem CID45267621
Molecular FormulaC19H21N3
Molecular Weight291.40 g/mol
Exact Mass291.17
IUPAC NameN-phenyl-N-piperidin-4-yl-1H-indol-5-amine
SMILESc1ccc(N(c2ccc3[nH]ccc3c2)C2CCNCC2)cc1
InChIInChI=1S/C19H21N3/c1-2-4-16(5-3-1)22(17-9-11-20-12-10-17)18-6-7-19-15(14-18)8-13-21-19/h1-8,13-14,17,20-21H,9-12H2
InChIKeyVJAXFVGMNNFSQS-UHFFFAOYSA-N
XLogP4.06
TPSA31.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.40
LogP ≤ 54.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1H-indole;1,4,7-triazonane
CID 158488040
N,N-dimethyl-1H-indol-5-amine
CID 23274
N,N-diethyl-4-[naphthalen-2-yl(piperidin-4-yl)amino]benzamide
CID 12988887
[3-[[1H-indol-5-yl(piperidin-4-yl)amino]methyl]-N-methylsulfonylanilino] 2,2,2-trifluoroacetate
CID 87090275
N-(azepan-4-yl)-1H-indol-5-amine
CID 113361399
4-benzylpiperidine;1H-indole-5-carboximidamide
CID 160594463
N-cyclopropyl-2-(1H-indol-5-yl)-N-methylquinolin-3-amine
CID 141344627
5-[(3S)-pyrrolidin-3-yl]oxy-1H-indole
CID 141128879
5-(pyrrolidin-3-ylmethyl)-1H-indole
CID 82607721
1H-indole;dihydrochloride
CID 18796541
N-(piperidin-4-ylmethyl)-1H-indole-5-carboxamide
CID 63747736
2-[cyclopentyl(1H-indole-5-carbonyl)amino]acetic acid
CID 63748053

Frequently Asked Questions

What is the IUPAC name of N-phenyl-N-piperidin-4-yl-1H-indol-5-amine?
The IUPAC name of N-phenyl-N-piperidin-4-yl-1H-indol-5-amine (CID 45267621) is N-phenyl-N-piperidin-4-yl-1H-indol-5-amine.
What is the SMILES notation for N-phenyl-N-piperidin-4-yl-1H-indol-5-amine?
The canonical SMILES for N-phenyl-N-piperidin-4-yl-1H-indol-5-amine is c1ccc(N(c2ccc3[nH]ccc3c2)C2CCNCC2)cc1.
What is the InChIKey of N-phenyl-N-piperidin-4-yl-1H-indol-5-amine?
The InChIKey is VJAXFVGMNNFSQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3/c1-2-4-16(5-3-1)22(17-9-11-20-12-10-17)18-6-7-19-15(14-18)8-13-21-19/h1-8,13-14,17,20-21H,9-12H2.
What are the key properties of N-phenyl-N-piperidin-4-yl-1H-indol-5-amine?
N-phenyl-N-piperidin-4-yl-1H-indol-5-amine has a molecular weight of 291.40 g/mol, XLogP of 4.06, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenyl-N-piperidin-4-yl-1H-indol-5-amine is sourced from PubChem (CID 45267621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).