N-[2-(2-methylpyrazol-3-yl)ethyl]-N-(piperidin-2-ylmethyl)propan-2-amine

C15H28N4 — CID 106632084

IUPACN-[2-(2-methylpyrazol-3-yl)ethyl]-N-(piperidin-2-ylmethyl)propan-2-amine
SMILESCC(C)N(CCc1ccnn1C)CC1CCCCN1
InChIInChI=1S/C15H28N4/c1-13(2)19(12-14-6-4-5-9-16-14)11-8-15-7-10-17-18(15)3/h7,10,13-14,16H,4-6,8-9,11-12H2,1-3H3
InChIKeyHXDPBAVZMWSOPA-UHFFFAOYSA-N
MW264.42 g/mol
LogP1.82
Rot. Bonds6

About N-[2-(2-methylpyrazol-3-yl)ethyl]-N-(piperidin-2-ylmethyl)propan-2-amine

N-[2-(2-methylpyrazol-3-yl)ethyl]-N-(piperidin-2-ylmethyl)propan-2-amine (PubChem CID 106632084) has the molecular formula C15H28N4 and a molecular weight of 264.42 g/mol. Its IUPAC name is N-[2-(2-methylpyrazol-3-yl)ethyl]-N-(piperidin-2-ylmethyl)propan-2-amine.

Molecular Properties

Compound NameN-[2-(2-methylpyrazol-3-yl)ethyl]-N-(piperidin-2-ylmethyl)propan-2-amine
PubChem CID106632084
Molecular FormulaC15H28N4
Molecular Weight264.42 g/mol
Exact Mass264.23
IUPAC NameN-[2-(2-methylpyrazol-3-yl)ethyl]-N-(piperidin-2-ylmethyl)propan-2-amine
SMILESCC(C)N(CCc1ccnn1C)CC1CCCCN1
InChIInChI=1S/C15H28N4/c1-13(2)19(12-14-6-4-5-9-16-14)11-8-15-7-10-17-18(15)3/h7,10,13-14,16H,4-6,8-9,11-12H2,1-3H3
InChIKeyHXDPBAVZMWSOPA-UHFFFAOYSA-N
XLogP1.82
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.42
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-(2-methylpyrazol-3-yl)ethyl]azepane
CID 103015057
N-[2-(2-methylpyrazol-3-yl)ethyl]-N-(pyrrolidin-2-ylmethyl)butan-1-amine
CID 106616829
N-[(2-ethylpyrazol-3-yl)methyl]-N-(pyrrolidin-2-ylmethyl)propan-2-amine
CID 106603092
2-[2-(2-methylpyrazol-3-yl)ethyl-propan-2-ylamino]ethanol
CID 103014020
N-(2-piperidin-1-ylethyl)-N-(piperidin-2-ylmethyl)propan-2-amine
CID 106631959
1-methyl-5-[2-(pyrrolidin-2-ylmethoxy)ethyl]pyrazole
CID 103004046
N-[(4-iodophenyl)methyl]-N-(piperidin-2-ylmethyl)propan-2-amine
CID 106631924
N-[(4-methyl-3-pyridinyl)methyl]-N-(piperidin-2-ylmethyl)propan-2-amine
CID 106621945
N-[(1,3-dimethylpyrazol-4-yl)methyl]-N-(piperidin-2-ylmethyl)propan-2-amine
CID 106622204
N-(piperidin-2-ylmethyl)-N-[(2-propan-2-yl-1,2,4-triazol-3-yl)methyl]propan-2-amine
CID 106632071
N-(2,3-dihydro-1H-inden-5-ylmethyl)-N-(piperidin-2-ylmethyl)propan-2-amine
CID 106631918
2-methyl-N-(piperidin-2-ylmethyl)-N-propylpyrazole-3-carboxamide
CID 106625760

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-methylpyrazol-3-yl)ethyl]-N-(piperidin-2-ylmethyl)propan-2-amine?
The IUPAC name of N-[2-(2-methylpyrazol-3-yl)ethyl]-N-(piperidin-2-ylmethyl)propan-2-amine (CID 106632084) is N-[2-(2-methylpyrazol-3-yl)ethyl]-N-(piperidin-2-ylmethyl)propan-2-amine.
What is the SMILES notation for N-[2-(2-methylpyrazol-3-yl)ethyl]-N-(piperidin-2-ylmethyl)propan-2-amine?
The canonical SMILES for N-[2-(2-methylpyrazol-3-yl)ethyl]-N-(piperidin-2-ylmethyl)propan-2-amine is CC(C)N(CCc1ccnn1C)CC1CCCCN1.
What is the InChIKey of N-[2-(2-methylpyrazol-3-yl)ethyl]-N-(piperidin-2-ylmethyl)propan-2-amine?
The InChIKey is HXDPBAVZMWSOPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N4/c1-13(2)19(12-14-6-4-5-9-16-14)11-8-15-7-10-17-18(15)3/h7,10,13-14,16H,4-6,8-9,11-12H2,1-3H3.
What are the key properties of N-[2-(2-methylpyrazol-3-yl)ethyl]-N-(piperidin-2-ylmethyl)propan-2-amine?
N-[2-(2-methylpyrazol-3-yl)ethyl]-N-(piperidin-2-ylmethyl)propan-2-amine has a molecular weight of 264.42 g/mol, XLogP of 1.82, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-methylpyrazol-3-yl)ethyl]-N-(piperidin-2-ylmethyl)propan-2-amine is sourced from PubChem (CID 106632084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).