6-[1-(1-tert-butyl-3-methylpyrazol-4-yl)ethylamino]-N-propylpyridine-3-carboxamide

C19H29N5O — CID 133477603

IUPAC6-[1-(1-tert-butyl-3-methylpyrazol-4-yl)ethylamino]-N-propylpyridine-3-carboxamide
SMILESCCCNC(=O)c1ccc(NC(C)c2cn(C(C)(C)C)nc2C)nc1
InChIInChI=1S/C19H29N5O/c1-7-10-20-18(25)15-8-9-17(21-11-15)22-13(2)16-12-24(19(4,5)6)23-14(16)3/h8-9,11-13H,7,10H2,1-6H3,(H,20,25)(H,21,22)
InChIKeyKFPNHEZHYJEJLN-UHFFFAOYSA-N
MW343.48 g/mol
LogP3.65
Rot. Bonds6

About 6-[1-(1-tert-butyl-3-methylpyrazol-4-yl)ethylamino]-N-propylpyridine-3-carboxamide

6-[1-(1-tert-butyl-3-methylpyrazol-4-yl)ethylamino]-N-propylpyridine-3-carboxamide (PubChem CID 133477603) has the molecular formula C19H29N5O and a molecular weight of 343.48 g/mol. Its IUPAC name is 6-[1-(1-tert-butyl-3-methylpyrazol-4-yl)ethylamino]-N-propylpyridine-3-carboxamide.

Molecular Properties

Compound Name6-[1-(1-tert-butyl-3-methylpyrazol-4-yl)ethylamino]-N-propylpyridine-3-carboxamide
PubChem CID133477603
Molecular FormulaC19H29N5O
Molecular Weight343.48 g/mol
Exact Mass343.24
IUPAC Name6-[1-(1-tert-butyl-3-methylpyrazol-4-yl)ethylamino]-N-propylpyridine-3-carboxamide
SMILESCCCNC(=O)c1ccc(NC(C)c2cn(C(C)(C)C)nc2C)nc1
InChIInChI=1S/C19H29N5O/c1-7-10-20-18(25)15-8-9-17(21-11-15)22-13(2)16-12-24(19(4,5)6)23-14(16)3/h8-9,11-13H,7,10H2,1-6H3,(H,20,25)(H,21,22)
InChIKeyKFPNHEZHYJEJLN-UHFFFAOYSA-N
XLogP3.65
TPSA71.84 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.48
LogP ≤ 53.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-[1-(1-tert-butyl-3-methylpyrazol-4-yl)ethylamino]-N-ethylpyridine-3-carboxamide
CID 133477615
N-[1-(1-tert-butyl-3-methylpyrazol-4-yl)ethyl]-5-chloropyridin-2-amine
CID 133477273
N-[1-(1-tert-butyl-3-methylpyrazol-4-yl)ethyl]-5-(difluoromethoxy)pyridin-2-amine
CID 133477434
6-(1-methylsulfanylpropan-2-ylamino)-N-propylpyridine-3-carboxamide
CID 133311932
ethyl 6-[1-(1,3-dimethylpyrazol-4-yl)ethylamino]pyridine-3-carboxylate
CID 122150645
6-[1-(2,5-dimethylthiophen-3-yl)ethylamino]-N-ethylpyridine-3-carboxamide
CID 133351105
N-[1-oxo-1-(propylamino)propan-2-yl]-6-(propylamino)pyridine-3-carboxamide
CID 62178002
N-(2-methylbutyl)-6-(propylamino)pyridine-3-carboxamide
CID 62693585
6-(2-phenylethylamino)-N-propylpyridine-3-carboxamide
CID 109151243
N-[2-(tert-butylamino)-2-oxoethyl]-6-(propylamino)pyridine-3-carboxamide
CID 115357188
N-(2-methoxyethyl)-6-(1-phenylethylamino)pyridine-3-carboxamide
CID 109152988
6-[[(1R)-2-methoxy-1-(5-methylfuran-2-yl)ethyl]amino]-N-propylpyridine-3-carboxamide
CID 97098793

Frequently Asked Questions

What is the IUPAC name of 6-[1-(1-tert-butyl-3-methylpyrazol-4-yl)ethylamino]-N-propylpyridine-3-carboxamide?
The IUPAC name of 6-[1-(1-tert-butyl-3-methylpyrazol-4-yl)ethylamino]-N-propylpyridine-3-carboxamide (CID 133477603) is 6-[1-(1-tert-butyl-3-methylpyrazol-4-yl)ethylamino]-N-propylpyridine-3-carboxamide.
What is the SMILES notation for 6-[1-(1-tert-butyl-3-methylpyrazol-4-yl)ethylamino]-N-propylpyridine-3-carboxamide?
The canonical SMILES for 6-[1-(1-tert-butyl-3-methylpyrazol-4-yl)ethylamino]-N-propylpyridine-3-carboxamide is CCCNC(=O)c1ccc(NC(C)c2cn(C(C)(C)C)nc2C)nc1.
What is the InChIKey of 6-[1-(1-tert-butyl-3-methylpyrazol-4-yl)ethylamino]-N-propylpyridine-3-carboxamide?
The InChIKey is KFPNHEZHYJEJLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29N5O/c1-7-10-20-18(25)15-8-9-17(21-11-15)22-13(2)16-12-24(19(4,5)6)23-14(16)3/h8-9,11-13H,7,10H2,1-6H3,(H,20,25)(H,21,22).
What are the key properties of 6-[1-(1-tert-butyl-3-methylpyrazol-4-yl)ethylamino]-N-propylpyridine-3-carboxamide?
6-[1-(1-tert-butyl-3-methylpyrazol-4-yl)ethylamino]-N-propylpyridine-3-carboxamide has a molecular weight of 343.48 g/mol, XLogP of 3.65, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[1-(1-tert-butyl-3-methylpyrazol-4-yl)ethylamino]-N-propylpyridine-3-carboxamide is sourced from PubChem (CID 133477603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).